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LIdj4hIiw50
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LIdj4hIiw50
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13C NMR
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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5-(N-Acetyl-sulfanilamido)-pentanoic acid
SpectraBase Compound ID JijjQd6eU0u
InChI InChI=1S/C13H18N2O5S/c1-10(16)15-11-5-7-12(8-6-11)21(19,20)14-9-3-2-4-13(17)18/h5-8,14H,2-4,9H2,1H3,(H,15,16)(H,17,18)
InChIKey MDQCVIUBEZSMMA-UHFFFAOYSA-N
Mol Weight 314.36 g/mol
Molecular Formula C13H18N2O5S
Exact Mass 314.093643 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LIdj4hIiw50
Name 5-(N-Acetyl-sulfanilamido)-pentanoic acid
CAS Registry Number 76464-76-1
Comments C5 IS C-13 AND N14 IS N-15 ENRICHED
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C13H18N2O5S
InChI InChI=1S/C13H18N2O5S/c1-10(16)15-11-5-7-12(8-6-11)21(19,20)14-9-3-2-4-13(17)18/h5-8,14H,2-4,9H2,1H3,(H,15,16)(H,17,18)
InChIKey MDQCVIUBEZSMMA-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference E. Leete, J.A. McDonell, J. Am. Chem. Soc. 658 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Acetone-D6
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